AG000L1K

123770-62-7 | ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate

AG000L1K

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CAS Number	123770-62-7
Catalog Number	AG000L1K(AGN-PC-0M79QS)
Chemical Name	ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate
IUPAC Name	ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate
InChI	InChI=1S/C7H9NO4/c1-2-11-7(10)6-3-5(4-9)12-8-6/h3,9H,2,4H2,1H3
InChI Key	ZWVVVEYXDQMHGQ-UHFFFAOYSA-N
MDL Number	MFCD08273501
Molecular Formula	C7H9NO4
Molecular Weight	171.1507
SMILES	OCC1=CC(=NO1)C(=O)OCC
Synonyms	ethyl 5-(hydroxymethyl)isoxazole-3-carboxylate, 123770-62-7, ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate, ZWVVVEYXDQMHGQ-UHFFFAOYSA-N, 3-Isoxazolecarboxylic acid, 5-(hydroxymethyl)-, ethyl ester, AK143189, 5-hydroxymethylisoxazole-3-carboxylic acid ethyl ester, 3-Isoxazolecarboxylicacid, 5-(hydroxymethyl)-, ethyl ester, AC1OXT4N, ACMC-1C7AP, SCHEMBL345384, AMOT0291, CTK4B3617, DTXSID40429014, ZINC6658113, ZX-RL004396, CE-821, MFCD08273501, SBB014324, STK689808, AKOS005602006, AM85519, MCULE-1902718186, QC-8364, AJ-56501, CS-10402, OR300632, SC-67119, AX8282624, DB-062181, ST4134061, TC-070023, CS-0043770, ethyl 5-hydroxymethylisoxazole-3-carboxylate, FT-0658985, ethyl 5(hydroxymethyl)isoxazole-3-carboxylate, Ethyl 5-(hydroxymethylisoxazole-3-carboxylate, ethyl 5-hydroxymethyl-isoxazole-3-carboxylate, J3.618.737I, ethyl 5-(hydroxymethyl)-isoxazole-3-carboxylate, A805147, S14-0049, 5-(hydroxymethyl)-3-isoxazolecarboxylic acid ethyl ester, 5-(Hydroxymethyl)isoxazole-3-carboxylic acid ethyl ester, 5-hydroxymethyl-isoxazole-3-carboxylic acid ethyl ester, ZINC06658113, CID8027233,

Complexity	162
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.053g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	171.152g/mol
Monoisotopic Mass	171.053g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	72.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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